Vitas-M small molecule compound
(2E)-1-(1,3-benzodioxol-5-yl)-3-[4-(dimethylamino)phenyl]prop-2-en-1-one
Catalog ID
STK306146
SMILES O=C(c1ccc2c(c1)OCO2)/C=C/c1ccc(cc1)N(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C18H17NO3 MW 295.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17NO3/c1-19(2)15-7-3-13(4-8-15)5-9-16(20)14-6-10-17-18(11-14)22-12-21-17/h3-11H,12H2,1-2H3/b9-5+InChIKey
MTVBOIXLVZSREL-WEVVVXLNSA-NSynonyms
928843-51-0(2E)1(13benzodioxol5yl)3(4(dimethylamino)phenyl)prop2en1one
(2E)1(13BENZODIOXOLE5YL)3(4(DIMETHYLAMINO)PHENYL)2PROPENE1ONE
(2E)1(2HBENZO(34D)13DIOXOLAN5YL)3(4(DIMETHYLAMINO)PHENYL)PROP2EN1ONE
(E)1(13benzodioxol5yl)3(4(dimethylamino)phenyl)prop2en1one
(E)1(13BENZODIOXOL5YL)3(4DIMETHYLAMINOPHENYL)PROP2EN1ONE
928843510
CN(C)C1=CC=C(C=C1)C=CC(=O)C2=CC3=C(C=C2)OCO3
InChI=1SC18H17NO3c119(2)157313(4815)5916(20)146101718(1114)22122117h311H12H212H3b95+
MFCD04052809
O=C(c1ccc2c(c1)OCO2)C=Cc1ccc(cc1)N(C)C
ZINC000006396094
ZINC06396094
ZINC6396094
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